Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 4/20 | 0.40 |
| ▸ | NOS1 | P29475 | 4/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 3/20 | 0.32 |
| ▸ | REN | P00797 | 1/20 | 0.31 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.31 |
| ▸ | SPR | P35270 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL17859601 | 0.89 | HTR1A (0.35) | NOS3NOS1NPY5RTSHRNOS2 | |
| SCHEMBL17525504 | 0.85 | NOS3 (0.41) | NOS3NOS1NPY5RTSHRNOS2 | |
| SCHEMBL17525505 | 0.84 | NOS3 (0.41) | NOS3NOS1NPY5RTSHRNOS2 | |
| SCHEMBL17525506 | 0.84 | NOS3 (0.40) | NOS3NOS1NPY5RNOS2HTR1A | |
| SCHEMBL17525502 | 0.83 | NOS3 (0.39) | NOS3NOS1NPY5RNOS2HTR1A | |
| SCHEMBL17525492 | 0.83 | NOS3 (0.38) | NOS3NOS1TSHRNOS2HTR1A | |
| SCHEMBL17525486 | 0.83 | NOS3 (0.40) | NOS3NOS1NPY5RNOS2REN | |
| SCHEMBL17859569 | 0.82 | NOS3 (0.38) | NOS3NOS1NPY5RTSHRNOS2 | |
| SCHEMBL17859566 | 0.82 | NOS3 (0.38) | NOS3NOS1NPY5RTSHRNOS2 | |
| SCHEMBL17859630 | 0.82 | NOS3 (0.38) | NOS3NOS1NPY5RNOS2REN |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016097023-A1 | CATIONIC BENZOXAZINE DERIVATIVES AND USE IN HAIR DYEING | L'OREAL (FR) | 2016-06-23 | — | — | WO | disclosed |